| SpectraBase Compound ID | Cl1CPhmpemd |
|---|---|
| InChI | InChI=1S/C14H24O2/c1-4-6-7-8-9-10-12-14(11-5-2)16-13(3)15/h14H,4-9,11H2,1-3H3 |
| InChIKey | VDRDKODCBDHTQV-UHFFFAOYSA-N |
| Mol Weight | 224.34 g/mol |
| Molecular Formula | C14H24O2 |
| Exact Mass | 224.17763 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IOm5KWmgts4 |
|---|---|
| Name | (1-Propylnon-2-ynyl) acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.177630011 u |
| Formula | C14H24O2 |
| InChI | InChI=1S/C14H24O2/c1-4-6-7-8-9-10-12-14(11-5-2)16-13(3)15/h14H,4-9,11H2,1-3H3 |
| InChIKey | VDRDKODCBDHTQV-UHFFFAOYSA-N |
| Molecular Weight | 224.344 g/mol |
| SMILES | C(C)(=O)OC(C#CCCCCCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915122 |